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BDBM50193997 6-(furan-3-yl)-2-(3H-imidazo[4,5-c]pyridin-3-yl)-N-((S)-1-methoxypropan-2-yl)pyrimidin-4-amine::CHEMBL220484::CHEMBL557844

SMILES: COC[C@H](C)Nc1cc(nc(n1)-n1cnc2ccncc12)-c1ccoc1

InChI Key: InChIKey=UTBPYMUVVZGFEJ-LBPRGKRZSA-N

Data: 4 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50193997   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50193997
PNG
(6-(furan-3-yl)-2-(3H-imidazo[4,5-c]pyridin-3-yl)-N...)
Show SMILES COC[C@H](C)Nc1cc(nc(n1)-n1cnc2ccncc12)-c1ccoc1
Show InChI InChI=1S/C18H18N6O2/c1-12(9-25-2)21-17-7-15(13-4-6-26-10-13)22-18(23-17)24-11-20-14-3-5-19-8-16(14)24/h3-8,10-12H,9H2,1-2H3,(H,21,22,23)/t12-/m0/s1
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PC sid
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Article
PubMed
n/an/a 51n/an/an/an/an/an/a



Procter and Gamble Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of JAK3


Bioorg Med Chem Lett 16: 5633-8 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.022
BindingDB Entry DOI: 10.7270/Q2J1040K
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50193997
PNG
(6-(furan-3-yl)-2-(3H-imidazo[4,5-c]pyridin-3-yl)-N...)
Show SMILES COC[C@H](C)Nc1cc(nc(n1)-n1cnc2ccncc12)-c1ccoc1
Show InChI InChI=1S/C18H18N6O2/c1-12(9-25-2)21-17-7-15(13-4-6-26-10-13)22-18(23-17)24-11-20-14-3-5-19-8-16(14)24/h3-8,10-12H,9H2,1-2H3,(H,21,22,23)/t12-/m0/s1
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PC sid
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Article
PubMed
n/an/a 446n/an/an/an/an/an/a



Procter and Gamble Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of JAK2


Bioorg Med Chem Lett 16: 5633-8 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.022
BindingDB Entry DOI: 10.7270/Q2J1040K
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK3


(Homo sapiens (Human))
BDBM50193997
PNG
(6-(furan-3-yl)-2-(3H-imidazo[4,5-c]pyridin-3-yl)-N...)
Show SMILES COC[C@H](C)Nc1cc(nc(n1)-n1cnc2ccncc12)-c1ccoc1
Show InChI InChI=1S/C18H18N6O2/c1-12(9-25-2)21-17-7-15(13-4-6-26-10-13)22-18(23-17)24-11-20-14-3-5-19-8-16(14)24/h3-8,10-12H,9H2,1-2H3,(H,21,22,23)/t12-/m0/s1
PDB

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Article
PubMed
n/an/a 165n/an/an/an/an/an/a



Procter and Gamble Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of JAK3


Bioorg Med Chem Lett 16: 5633-8 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.022
BindingDB Entry DOI: 10.7270/Q2J1040K
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50193997
PNG
(6-(furan-3-yl)-2-(3H-imidazo[4,5-c]pyridin-3-yl)-N...)
Show SMILES COC[C@H](C)Nc1cc(nc(n1)-n1cnc2ccncc12)-c1ccoc1
Show InChI InChI=1S/C18H18N6O2/c1-12(9-25-2)21-17-7-15(13-4-6-26-10-13)22-18(23-17)24-11-20-14-3-5-19-8-16(14)24/h3-8,10-12H,9H2,1-2H3,(H,21,22,23)/t12-/m0/s1
PDB

Reactome pathway
KEGG

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antibodypedia
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 141n/an/an/an/an/an/a



Procter and Gamble Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of JAK2


Bioorg Med Chem Lett 16: 5633-8 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.022
BindingDB Entry DOI: 10.7270/Q2J1040K
More data for this
Ligand-Target Pair